SCHEMBL31468352

SCHEMBL31468352

O=C(O)c1ccc(-c2cc(=O)n3nc(-c4ccccc4F)cc3[nH]2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.43
KDM4C Q9H3R0 1/20 0.43
KDM5B Q9UGL1 1/20 0.43
ADORA3 P0DMS8 1/20 0.42
TTR P02766 1/20 0.40
GCGR P47871 1/20 0.39
MAPK14 Q16539 1/20 0.39
LDHA P00338 2/20 0.39
PARP1 P09874 3/20 0.38
ATM Q13315 1/20 0.38
MAOA P21397 1/20 0.38
BLVRB P30043 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
CDC7 O00311 1/20 0.37
MAPT P10636 1/20 0.36
ACMSD Q8TDX5 1/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31468318 0.88 NPC1 (0.41) ADORA3MAPK14PARP1
SCHEMBL31468374 0.87 PARP1 (0.49) PARP1CDC7CASP3SENP8SENP7
SCHEMBL31468410 0.84 PARP1 (0.45) PARP1CDC7MAPT
SCHEMBL31468381 0.78 KDM5A (0.41) KDM5AKDM4CKDM5BTTRGCGR
SCHEMBL31468348 0.77 PARP1 (0.58) MAPK14PARP1CDC7MAPT
SCHEMBL31468373 0.77 NR1H4 (0.46) PARP1
SCHEMBL31468434 0.76 MEN1 (0.49) PARP1MAPT
SCHEMBL31468311 0.75 PARP1 (0.44) ADORA3PARP1CDC7MAPT
SCHEMBL31468300 0.75 PARP1 (0.44) ADORA3PARP1CDC7MAPT
SCHEMBL4707821 0.72 ERCC1 (0.48) KDM5AKDM4CKDM5BLDHAPARP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025064210-A1 INHIBITORS OF BILIVERDIN REDUCTASE B (BLVRB) BLOOD CELL TECHNOLOGIES, LLC (US) 2025-03-27 WO disclosed